1-(3-Chlorophenyl)imidazolidin-2-one
Basic information
- CAS
14088-98-3- Standard SMILES
O=C1NCCN1c1cccc(Cl)c1- InChIKey
XQRTVHGPSVYJAS-UHFFFAOYSA-N- Molecular formula
- C9H9ClN2O
- Average molar mass
- 196.63 g/mol
- Monoisotopic mass
- 196.0403406
Names & identifiers
- Preferred name
- 1-(3-Chlorophenyl)imidazolidin-2-one
- IUPAC
- 1-(3-chlorophenyl)imidazolidin-2-one
- English name
- 1-(3-Chlorophenyl)imidazolidin-2-one
- Molecular formula
- C9H9ClN2O
- Molecular weight
- 196.63
Names & synonyms
1-(3-Chlorophenyl)imidazolidin-2-one14088-98-32-Imidazolidinone, 1-(3-chlorophenyl)-MFCD00022406EINECS 237-935-01-(3-Chlorophenyl)-2-imidazolidinone3-chlorophenyl-imidazolidinoneSCHEMBL7344849DTXSID009309341-(m-chloropTM66M9PXX51-(m-chlorophenyl)-2-imidazolidinone
Show more names
1101-71-[(5S,10S,13S)-10,13-dimethyl-3-(1-methyl-1-pyrrolidin-1-iumyl)-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]-1-methylpyrrolidin-1-ium diiodide
AKOS015915267CS-W006322DS-4498SY114311NS00052240A11003F2381671-(3-Chlorophenyl)-4,5-dihydro-1H-imidazol-2-ol
Database identifiers
- CAS
14088-98-3- PubChem CID
- 84190
- DTXSID
DTXSID00930934- UNII
- TM66M9PXX5
- EC Number
- 237-935-0
- Nikkaji
- J216.861H
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 32.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 210
Physicochemical properties
- Melting point
- 121 °C · 121 °C(Solv: ethyl ether (60-29-7))
- Density
- 1.324 · 1.324±0.06 g/cm3(Predicted)
- storage temp.
- Sealed in dry,Room Temperature
- pka
- 13.85 · 13.85±0.20(Predicted)
- Appearance
- White to off-white Solid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H332-H335
- Precautionary statements
- 261 · P261-P280-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H332-H335
- Precautionary statements
- P261-P280-P305+P351+P338
Related reactions
3 records
Compound notes
Loading…